1-[[6-oxidanylidene-1-(phenylmethyl)pyridin-3-yl]carbonylamino]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[[6-oxidanylidene-1-(phenylmethyl)pyridin-3-yl]carbonylamino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[(1-benzyl-6-oxo-pyridine-3-carbonyl)amino]thiourea CAS Name: 1-[[oxo-[6-oxo-1-(phenylmethyl)-3-pyridinyl]methyl]amino]-3-prop-2-enylthiourea IUPAC Name: 1-[(1-benzyl-6-oxopyridine-3-carbonyl)amino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[(1-benzyl-6-keto-nicotinoyl)amino]thiourea Formula: C17H18N4O2S MolecularWeight: 342.41542

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NNC(=O)C1=CN(C(=O)C=C1)CC2=CC=CC=C2

Isomeric SMILES

C=CCNC(=S)NNC(=O)C1=CN(C(=O)C=C1)CC2=CC=CC=C2

InChI

InChI=1S/C17H18N4O2S/c1-2-10-18-17(24)20-19-16(23)14-8-9-15(22)21(12-14)11-13-6-4-3-5-7-13/h2-9,12H,1,10-11H2,(H,19,23)(H2,18,20,24)